Information card for entry 4339069

Structure parameters

• Formula: C46 H52.5 Ho Mo12 N9.5 O56 Si
• Calculated formula: C46 H42 Ho Mo12 N9.5 O56 Si
• Title of publication: Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.
• Authors of publication: Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 5957 - 5966
• a: 13.21 ± 0.003 Å
• b: 16.532 ± 0.003 Å
• c: 18.518 ± 0.004 Å
• α: 88.736 ± 0.004°
• β: 81.983 ± 0.004°
• γ: 83.31 ± 0.004°
• Cell volume: 3977.2 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0868
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1212
• Weighted residual factors for all reflections included in the refinement: 0.1301
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No